1-[(E)-[(3-nitrophenyl)-pyridin-2-yl-methylidene]amino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-[(3-nitrophenyl)-pyridin-2-yl-methylidene]amino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-[(3-nitrophenyl)-(2-pyridyl)methylene]amino]thiourea CAS Name: 1-[(E)-[(3-nitrophenyl)-(2-pyridinyl)methylidene]amino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-[(3-nitrophenyl)-pyridin-2-ylmethylidene]amino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-[(3-nitrophenyl)-(2-pyridyl)methylene]amino]thiourea Formula: C16H15N5O2S MolecularWeight: 341.3876

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NN=C(C1=CC(=CC=C1)[N+](=O)[O-])C2=CC=CC=N2

Isomeric SMILES

C=CCNC(=S)N/N=C(\C1=CC(=CC=C1)[N+](=O)[O-])/C2=CC=CC=N2

InChI

InChI=1S/C16H15N5O2S/c1-2-9-18-16(24)20-19-15(14-8-3-4-10-17-14)12-6-5-7-13(11-12)21(22)23/h2-8,10-11H,1,9H2,(H2,18,20,24)/b19-15+